N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | G015-0664 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[5-(4-ethylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 470.59 |
| Molecular Formula: | C23 H30 N6 O3 S |
| Smiles: | CCN1CCN(CC1)c1nnc(n2cccc2C(NCCc2ccc(c(c2)OC)OC)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.5443 |
| logD: | 1.6871 |
| logSw: | -2.8963 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.926 |
| InChI Key: | YZRYCTJTYGYAKT-UHFFFAOYSA-N |